Geometry & MOs

Info

ID:	342629
PubChem CID:	127265789
Reduced:	N2O3C13H18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	255.183444
ΔH_f, kcal/mol:	-104.85
Dipole, Da:	5.32
IP(EA), eV:	-9.15(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethoxy-1-hydroxy-2,2-dimethylcyclobutyl)methyl]-2-methylbut-2-enamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C=CC(=O)N(CC)CC(=O)N

DOS

IR

Vibrations